General Information of the Compound
| Compound ID |
CP0428359
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| Compound Name |
4-(5-(4-Chlorophenyl)-2-methyl-3-(4-methylbenzoyl)-1H-pyrrol-1-yl)benzenesulfonamide
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| Structure |
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| Formula |
C25H21ClN2O3S
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| Molecular Weight |
464.974
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| Canonical SMILES |
Cc1c(cc(-c2ccc(Cl)cc2)n1-c1ccc(cc1)S(N)(=O)=O)C(=O)c1ccc(C)cc1
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| InChI |
InChI=1S/C25H21ClN2O3S/c1-16-3-5-19(6-4-16)25(29)23-15-24(18-7-9-20(26)10-8-18)28(17(23)2)21-11-13-22(14-12-21)32(27,30)31/h3-15H,1-2H3,(H2,27,30,31)
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| InChIKey |
GDZQFOHTLPJYBU-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound